6-(2,2-dimethylpropylamino)hexan-1-ol

C11H25NO — CID 115909001

IUPAC6-(2,2-dimethylpropylamino)hexan-1-ol
SMILESCC(C)(C)CNCCCCCCO
InChIInChI=1S/C11H25NO/c1-11(2,3)10-12-8-6-4-5-7-9-13/h12-13H,4-10H2,1-3H3
InChIKeyRLNWTPKOCVZIDW-UHFFFAOYSA-N
MW187.33 g/mol
LogP2.17
Rot. Bonds7

About 6-(2,2-dimethylpropylamino)hexan-1-ol

6-(2,2-dimethylpropylamino)hexan-1-ol (PubChem CID 115909001) has the molecular formula C11H25NO and a molecular weight of 187.33 g/mol. Its IUPAC name is 6-(2,2-dimethylpropylamino)hexan-1-ol.

Molecular Properties

Compound Name6-(2,2-dimethylpropylamino)hexan-1-ol
PubChem CID115909001
Molecular FormulaC11H25NO
Molecular Weight187.33 g/mol
Exact Mass187.19
IUPAC Name6-(2,2-dimethylpropylamino)hexan-1-ol
SMILESCC(C)(C)CNCCCCCCO
InChIInChI=1S/C11H25NO/c1-11(2,3)10-12-8-6-4-5-7-9-13/h12-13H,4-10H2,1-3H3
InChIKeyRLNWTPKOCVZIDW-UHFFFAOYSA-N
XLogP2.17
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.33
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

5-(4-hydroxybutylamino)-4,4-dimethylpentan-1-ol
CID 106147208
2-[(4-hydroxybutylamino)methyl]-2-methylpropane-1,3-diol
CID 106841911
6-[(2-ethoxy-2-methylpropyl)amino]hexan-1-ol
CID 107703685
12-(12-hydroxydodecylamino)dodecan-1-ol
CID 18618691
N-(2,2-dimethylpropyl)-9-methyldecan-1-amine
CID 146339864
(2R)-2-(3,3-dimethylbutyl)-7-(2,2-dimethylpropylamino)heptan-1-ol
CID 118887577
8-(undecylamino)octan-1-ol
CID 139305047
12-(tert-butylamino)dodecan-1-ol
CID 159274393
4-[3-[4-[3-(4-hydroxybutylamino)propylamino]butylamino]propylamino]butan-1-ol
CID 178169165
1-(4-hydroxybutylamino)-4-methoxy-2-methylbutan-2-ol
CID 106254985
5-(4-methoxybutylamino)-4,4-dimethylpentan-1-ol
CID 106147134
N'-(2,2-dimethylpropyl)ethane-1,2-diamine
CID 61168060

Frequently Asked Questions

What is the IUPAC name of 6-(2,2-dimethylpropylamino)hexan-1-ol?
The IUPAC name of 6-(2,2-dimethylpropylamino)hexan-1-ol (CID 115909001) is 6-(2,2-dimethylpropylamino)hexan-1-ol.
What is the SMILES notation for 6-(2,2-dimethylpropylamino)hexan-1-ol?
The canonical SMILES for 6-(2,2-dimethylpropylamino)hexan-1-ol is CC(C)(C)CNCCCCCCO.
What is the InChIKey of 6-(2,2-dimethylpropylamino)hexan-1-ol?
The InChIKey is RLNWTPKOCVZIDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO/c1-11(2,3)10-12-8-6-4-5-7-9-13/h12-13H,4-10H2,1-3H3.
What are the key properties of 6-(2,2-dimethylpropylamino)hexan-1-ol?
6-(2,2-dimethylpropylamino)hexan-1-ol has a molecular weight of 187.33 g/mol, XLogP of 2.17, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,2-dimethylpropylamino)hexan-1-ol is sourced from PubChem (CID 115909001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).